From: hackbard Date: Mon, 12 Apr 2010 15:00:14 +0000 (+0200) Subject: added accelerated md approaches X-Git-Url: https://hackdaworld.org/cgi-bin/gitweb.cgi?a=commitdiff_plain;h=a0798487dcdcfa5bcb019a03daa57c8afc298edc;p=lectures%2Flatex.git added accelerated md approaches --- diff --git a/bibdb/bibdb.bib b/bibdb/bibdb.bib index 0bb81b3..1d44eb2 100644 --- a/bibdb/bibdb.bib +++ b/bibdb/bibdb.bib @@ -1510,3 +1510,114 @@ author = "K. Nordlund", year = "2008", } + +@Article{voter97, + title = "Hyperdynamics: Accelerated Molecular Dynamics of + Infrequent Events", + author = "Arthur F. Voter", + journal = "Phys. Rev. Lett.", + volume = "78", + number = "20", + pages = "3908--3911", + numpages = "3", + year = "1997", + month = may, + doi = "10.1103/PhysRevLett.78.3908", + publisher = "American Physical Society", + notes = "hyperdynamics, accelerated md", +} + +@Article{voter97_2, + author = "Arthur F. Voter", + collaboration = "", + title = "A method for accelerating the molecular dynamics + simulation of infrequent events", + publisher = "AIP", + year = "1997", + journal = "The Journal of Chemical Physics", + volume = "106", + number = "11", + pages = "4665--4677", + keywords = "COMPUTERIZED SIMULATION; NICKEL; DIFFUSION; ATOM + TRANSPORT; MOLECULAR ORBITAL METHOD; POTENTIAL ENERGY; + SURFACE POTENTIAL; MOLECULAR DYNAMICS METHOD; potential + energy functions; surface diffusion; reaction kinetics + theory; potential energy surfaces", + URL = "http://link.aip.org/link/?JCP/106/4665/1", + doi = "10.1063/1.473503", + notes = "improved hyperdynamics md", +} + +@Article{sorensen2000, + author = "Mads R. S\o rensen and Arthur F. Voter", + collaboration = "", + title = "Temperature-accelerated dynamics for simulation of + infrequent events", + publisher = "AIP", + year = "2000", + journal = "The Journal of Chemical Physics", + volume = "112", + number = "21", + pages = "9599--9606", + keywords = "SOLID STATE PHYSICS; SIMULATION; DIFFUSION; SURFACES; + MOLECULAR DYNAMICS METHOD; surface diffusion", + URL = "http://link.aip.org/link/?JCP/112/9599/1", + doi = "10.1063/1.481576", + notes = "temperature accelerated dynamics, tad", +} + +@Article{voter98, + title = "Parallel replica method for dynamics of infrequent + events", + author = "Arthur F. Voter", + journal = "Phys. Rev. B", + volume = "57", + number = "22", + pages = "R13985--R13988", + numpages = "3", + year = "1998", + month = jun, + doi = "10.1103/PhysRevB.57.R13985", + publisher = "American Physical Society", + notes = "parallel replica method, accelerated md", +} + +@Article{wu99, + author = "Xiongwu Wu and Shaomeng Wang", + collaboration = "", + title = "Enhancing systematic motion in molecular dynamics + simulation", + publisher = "AIP", + year = "1999", + journal = "The Journal of Chemical Physics", + volume = "110", + number = "19", + pages = "9401--9410", + keywords = "molecular dynamics method; argon; Lennard-Jones + potential; crystallisation; liquid theory", + URL = "http://link.aip.org/link/?JCP/110/9401/1", + doi = "10.1063/1.478948", + notes = "self guided md, sgmd, accelerated md, enhancing + systematic motion", +} + +@Article{choudhary05, + author = "Devashish Choudhary and Paulette Clancy", + collaboration = "", + title = "Application of accelerated molecular dynamics schemes + to the production of amorphous silicon", + publisher = "AIP", + year = "2005", + journal = "The Journal of Chemical Physics", + volume = "122", + number = "15", + eid = "154509", + numpages = "8", + pages = "154509", + keywords = "molecular dynamics method; silicon; glass structure; + amorphous semiconductors", + URL = "http://link.aip.org/link/?JCP/122/154509/1", + doi = "10.1063/1.1878733", + notes = "explanation of sgmd and hyper md, applied to amorphous + silicon", +}